SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'ETE'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)

Filter list by:

	DrReposER ID / Desc.	Hit PDBID	Hit Macromolecule	Res. Matches	Interface	HETATM	RMSD	Dali Z-score	Seq. Identity (%)
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	3V35_A_NTIA317_1 (ALDOSE REDUCTASE)	2vro	ALDEHYDE DEHYDROGENASE (Paraburkholderia xenovorans)	4 / 8	VAL A 479 TRP A 163 HIS A 485 PHE A 160	ETE A1524 (-4.2A) ETE A1524 (-3.9A) None ETE A1524 (-4.0A)	1.49A	3v35A-2vroA: undetectable	3v35A-2vroA: 21.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5FHZ_A_REAA602_1 (ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A3)	2vro	ALDEHYDE DEHYDROGENASE (Paraburkholderia xenovorans)	5 / 12	GLY A 104 THR A 108 TRP A 163 CYH A 296 THR A 297	ETE A1524 (-3.5A) None ETE A1524 (-3.9A) None ETE A1524 ( 4.1A)	1.11A	5fhzA-2vroA: 42.3	5fhzA-2vroA: 25.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5FHZ_D_READ602_1 (ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A3)	2vro	ALDEHYDE DEHYDROGENASE (Paraburkholderia xenovorans)	6 / 12	GLY A 104 ASN A 159 TRP A 163 GLU A 257 CYH A 296 THR A 297	ETE A1524 (-3.5A) None ETE A1524 (-3.9A) None None ETE A1524 ( 4.1A)	1.21A	5fhzD-2vroA: 41.3	5fhzD-2vroA: 25.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.	5FHZ_D_READ602_1 (ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A3)	2vro	ALDEHYDE DEHYDROGENASE (Paraburkholderia xenovorans)	5 / 12	GLY A 105 ASN A 159 GLU A 257 CYH A 296 THR A 297	None None None None ETE A1524 ( 4.1A)	1.18A	5fhzD-2vroA: 41.3	5fhzD-2vroA: 25.96

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["3V35_A_NTIA317_1","ALDOSE REDUCTASE","2vro","ALDEHYDE DEHYDROGENASE","Paraburkholderia xenovorans",4,"VAL A 479;TRP A 163;HIS A 485;PHE A 160","ETE A1524 (-4.2A);ETE A1524 (-3.9A);None;ETE A1524 (-4.0A)","1.49A","3v35A-2vroA:undetectable",null],["5FHZ_A_REAA602_1","ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A3","2vro","ALDEHYDE DEHYDROGENASE","Paraburkholderia xenovorans",5,"GLY A 104;THR A 108;TRP A 163;CYH A 296;THR A 297","ETE A1524 (-3.5A);None;ETE A1524 (-3.9A);None;ETE A1524 ( 4.1A)","1.11A","5fhzA-2vroA:42.3","3v35A-2vroA:21.04"],["5FHZ_D_READ602_1","ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A3","2vro","ALDEHYDE DEHYDROGENASE","Paraburkholderia xenovorans",6,"GLY A 104;ASN A 159;TRP A 163;GLU A 257;CYH A 296;THR A 297","ETE A1524 (-3.5A);None;ETE A1524 (-3.9A);None;None;ETE A1524 ( 4.1A)","1.21A","5fhzD-2vroA:41.3","5fhzA-2vroA:25.96"],["5FHZ_D_READ602_1","ALDEHYDE DEHYDROGENASE FAMILY 1 MEMBER A3","2vro","ALDEHYDE DEHYDROGENASE","Paraburkholderia xenovorans",5,"GLY A 105;ASN A 159;GLU A 257;CYH A 296;THR A 297","None;None;None;None;ETE A1524 ( 4.1A)","1.18A","5fhzD-2vroA:41.3","5fhzD-2vroA:25.96"]]